input word = C00047857

Metabolite InformationStructural formula
Name Epicoccin E
(+)-Epicoccin E
Formula C18H18N2O7S2
Mw 438.05554241
CAS RN 1196688-67-1
C_ID C00047857 ,
InChIKey KVJHKMONYMMFLY-RYKHKVHRNA-N
InChICode InChI=1S/C18H18N2O7S2/c21-6-1-7-11(23)8-4(6)2-17(28-7)15(26)20-9-5-3-18(20,16(27)19(8)17)29-14(10(5)22)13(25)12(9)24/h4-5,7-9,11-14,23-25H,1-3H2/t4-,5+,7+,8-,9-,11-,12+,13+,14+,17+,18+/m0/s1
SMILES O=C1C[C@H]2S[C@@]34C[C@@H]1[C@@H]([C@H]2O)N3C(=O)[C@@]12C[C@H]3C(=O)[C@@H](S1)[C@H](O)[C@H](O)[C@H]3N2C4=O
Start Substs in Alk. Biosynthesis (Prediction) L-Lys L-Arg L-Asp
Organism
Kingdom Family Species Reference
FungiIncertae sedisEpicoccum nigrum Ref.
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